| SpectraBase Spectrum ID |
6CpYw5Yfpgw |
| Name |
Ethyl 4,6-bis(9'-benzyl-6'-purinyl)-2-ethoxycarbonylhexanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H36N8O4 |
| InChI |
InChI=1S/C35H36N8O4/c1-3-46-34(44)27(35(45)47-4-2)17-26(29-31-33(39-21-37-29)43(23-41-31)19-25-13-9-6-10-14-25)15-16-28-30-32(38-20-36-28)42(22-40-30)18-24-11-7-5-8-12-24/h5-14,20-23,26-27H,3-4,15-19H2,1-2H3 |
| InChIKey |
UJDKQBWKCRCNSG-UHFFFAOYSA-N |
| Molecular Weight |
632.725 g/mol |
| SMILES |
c12c([n](Cc3ccccc3)cn1)ncnc2C(CC(C(=O)OCC)C(=O)OCC)CCc1c2c([n](Cc3ccccc3)cn2)ncn1 |
| SPLASH |
splash10-0006-9022000000-c78be588d7e84021d0de |
| Source of Spectrum |
SB-51-1123-12 |
| Synonyms |
Diethyl 2-[2,4-bis(9-benzyl-9H-purin-6-yl)butyl]malonate |
| Wiley ID |
1412195 |
